N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

C25H27N3O4S — CID 55723581

IUPACN-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESCS(=O)(=O)Nc1ccccc1CNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C25H27N3O4S/c1-33(31,32)27-23-12-5-3-8-20(23)17-26-24(29)19-13-15-28(16-14-19)25(30)22-11-6-9-18-7-2-4-10-21(18)22/h2-12,19,27H,13-17H2,1H3,(H,26,29)
InChIKeyJLKBPGASEVLOOC-UHFFFAOYSA-N
MW465.58 g/mol
LogP3.38
Rot. Bonds6

About N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide

N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (PubChem CID 55723581) has the molecular formula C25H27N3O4S and a molecular weight of 465.58 g/mol. Its IUPAC name is N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
PubChem CID55723581
Molecular FormulaC25H27N3O4S
Molecular Weight465.58 g/mol
Exact Mass465.17
IUPAC NameN-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
SMILESCS(=O)(=O)Nc1ccccc1CNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1
InChIInChI=1S/C25H27N3O4S/c1-33(31,32)27-23-12-5-3-8-20(23)17-26-24(29)19-13-15-28(16-14-19)25(30)22-11-6-9-18-7-2-4-10-21(18)22/h2-12,19,27H,13-17H2,1H3,(H,26,29)
InChIKeyJLKBPGASEVLOOC-UHFFFAOYSA-N
XLogP3.38
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.58
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[4-(methylsulfonylmethyl)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55898961
N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 55725408
N-[(4-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396099
1-(naphthalene-1-carbonyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 17465771
N-(3-aminopropyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 119405475
N-[[4-(methoxymethyl)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 46415724
N-[2-(2-fluorophenyl)ethyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27848033
N-(3-methoxypropyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 17465957
1-methylsulfonyl-N-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 95945588
N-[(3-chlorophenyl)methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27535031
methyl 2-[[1-(naphthalene-1-carbonyl)piperidine-4-carbonyl]amino]benzoate
CID 55430267
N-(2-fluorophenyl)-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27396109

Frequently Asked Questions

What is the IUPAC name of N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide (CID 55723581) is N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is CS(=O)(=O)Nc1ccccc1CNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1.
What is the InChIKey of N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
The InChIKey is JLKBPGASEVLOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O4S/c1-33(31,32)27-23-12-5-3-8-20(23)17-26-24(29)19-13-15-28(16-14-19)25(30)22-11-6-9-18-7-2-4-10-21(18)22/h2-12,19,27H,13-17H2,1H3,(H,26,29).
What are the key properties of N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide?
N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide has a molecular weight of 465.58 g/mol, XLogP of 3.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(methanesulfonamido)phenyl]methyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 55723581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).